(E)-3-(Dimethylamino)-2-(2,2,2-trifluoro-1-hydrazino-1-hydroxyethyl)-2-propenenitrile CAS 400086-95-5
| CAS No. | 400086-95-5 |
| Molecular Formula | C7H11F3N4O |
| Molecular Weight | 224.18 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (E)-3-(Dimethylamino)-2-(2,2,2-trifluoro-1-hydrazino-1-hydroxyethyl)-2-propenenitrile is closely related to an amide group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
(E)-3-(Dimethylamino)-2-(2,2,2-trifluoro-1-hydrazino-1-hydroxyethyl)-2-propenenitrile (CAS 400086-95-5), molecular formula C7H11F3N4O and molecular weight 224.18 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C7H11F3N4O, (E)-3-(Dimethylamino)-2-(2,2,2-trifluoro-1-hydrazino-1-hydroxyethyl)-2-propenenitrile contains an amide group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 224.18 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
As a certified reference material (CRM), (E)-3-(Dimethylamino)-2-(2,2,2-trifluoro-1-hydrazino-1-hydroxyethyl)-2-propenenitrile meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C7H11F3N4O |
| Molecular Weight | 224.18 g/mol |
| Appearance | White to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 3.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |
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Recommended Standards
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- N-((1-Isopropyl-1H-pyrazol-4-yl)methyl)-3-methoxy-1-methyl-1H-pyrazol-4-amine hydrochloride (CAS 1856026-77-1)
- Ethyl 2-(4-(cyclopropylsulfonyl)phenyl)-2-oxoacetate (CAS 876063-40-0)
- 6-(4-Methoxyphenyl)picolinimidamide hydrochloride (CAS 1179361-82-0)
- Tirzepatide Impurity 34 (CAS CATO-C4X-324034)
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